Geometry & MOs

Info

ID:	136891
PubChem CID:	52119646
Reduced:	O3N4C18H22 (1)
Stoich.:	A3B4C18D22 (1)
Weight, g/mol:	442.104397
ΔH_f, kcal/mol:	-69.71
Dipole, Da:	4.96
IP(EA), eV:	-8.91(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-6-oxo-N-phenylpyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CCCCN(C)C(=O)CN1C(=O)C=CC(=N1)C(=O)NC2=CC=CC=C2

DOS

IR

Vibrations